5-[5-(3-oxidanyl-2-phenyl-propanoyl)-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]thiophene-2-carboxylic acid

Systemtic Name: 5-[5-(3-oxidanyl-2-phenyl-propanoyl)-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]thiophene-2-carboxylic acid Openeye Name: 5-[5-(3-hydroxy-2-phenyl-propanoyl)-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]thiophene-2-carboxylic acid CAS Name: 5-[5-(3-hydroxy-1-oxo-2-phenylpropyl)-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]-2-thiophenecarboxylic acid IUPAC Name: 5-[5-(3-hydroxy-2-phenylpropanoyl)-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]thiophene-2-carboxylic acid Traditional Name: 5-(5-tropoyl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl)-2-thenoic acid Formula: C19H17N3O4S MolecularWeight: 383.42098

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(CN1C(=O)C(CO)C3=CC=CC=C3)NN=C2C4=CC=C(S4)C(=O)O

Isomeric SMILES

C1C2=C(CN1C(=O)C(CO)C3=CC=CC=C3)NN=C2C4=CC=C(S4)C(=O)O

InChI

InChI=1S/C19H17N3O4S/c23-10-13(11-4-2-1-3-5-11)18(24)22-8-12-14(9-22)20-21-17(12)15-6-7-16(27-15)19(25)26/h1-7,13,23H,8-10H2,(H,20,21)(H,25,26)